butyl-(2,3-dimethylphenoxy)-dimethylsilane

C14H24OSi — CID 90427647

IUPACbutyl-(2,3-dimethylphenoxy)-dimethylsilane
SMILESCCCC[Si](C)(C)Oc1cccc(C)c1C
InChIInChI=1S/C14H24OSi/c1-6-7-11-16(4,5)15-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3
InChIKeyDLVAUJRYTMQYCF-UHFFFAOYSA-N
MW236.43 g/mol
LogP4.69
Rot. Bonds5

About butyl-(2,3-dimethylphenoxy)-dimethylsilane

butyl-(2,3-dimethylphenoxy)-dimethylsilane (PubChem CID 90427647) has the molecular formula C14H24OSi and a molecular weight of 236.43 g/mol. Its IUPAC name is butyl-(2,3-dimethylphenoxy)-dimethylsilane.

Molecular Properties

Compound Namebutyl-(2,3-dimethylphenoxy)-dimethylsilane
PubChem CID90427647
Molecular FormulaC14H24OSi
Molecular Weight236.43 g/mol
Exact Mass236.16
IUPAC Namebutyl-(2,3-dimethylphenoxy)-dimethylsilane
SMILESCCCC[Si](C)(C)Oc1cccc(C)c1C
InChIInChI=1S/C14H24OSi/c1-6-7-11-16(4,5)15-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3
InChIKeyDLVAUJRYTMQYCF-UHFFFAOYSA-N
XLogP4.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of butyl-(2,3-dimethylphenoxy)-dimethylsilane?
The IUPAC name of butyl-(2,3-dimethylphenoxy)-dimethylsilane (CID 90427647) is butyl-(2,3-dimethylphenoxy)-dimethylsilane.
What is the SMILES notation for butyl-(2,3-dimethylphenoxy)-dimethylsilane?
The canonical SMILES for butyl-(2,3-dimethylphenoxy)-dimethylsilane is CCCC[Si](C)(C)Oc1cccc(C)c1C.
What is the InChIKey of butyl-(2,3-dimethylphenoxy)-dimethylsilane?
The InChIKey is DLVAUJRYTMQYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24OSi/c1-6-7-11-16(4,5)15-14-10-8-9-12(2)13(14)3/h8-10H,6-7,11H2,1-5H3.
What are the key properties of butyl-(2,3-dimethylphenoxy)-dimethylsilane?
butyl-(2,3-dimethylphenoxy)-dimethylsilane has a molecular weight of 236.43 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-(2,3-dimethylphenoxy)-dimethylsilane is sourced from PubChem (CID 90427647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).